UCSF

ZINC34553140

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2009 26 No

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -4.84 5.44 -75.51 2 11 -1 153 373.386 6
Hi High (pH 8-9.5) -4.84 3.68 -123.46 1 11 -2 152 372.378 6

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )